N-(1-methylpyrazol-4-yl)-4-propan-2-yloxypyrimidin-2-amine

C11H15N5O — CID 112636750

IUPACN-(1-methylpyrazol-4-yl)-4-propan-2-yloxypyrimidin-2-amine
SMILESCC(C)Oc1ccnc(Nc2cnn(C)c2)n1
InChIInChI=1S/C11H15N5O/c1-8(2)17-10-4-5-12-11(15-10)14-9-6-13-16(3)7-9/h4-8H,1-3H3,(H,12,14,15)
InChIKeyQUYHQHKYYFGXBM-UHFFFAOYSA-N
MW233.28 g/mol
LogP1.74
Rot. Bonds4

About N-(1-methylpyrazol-4-yl)-4-propan-2-yloxypyrimidin-2-amine

N-(1-methylpyrazol-4-yl)-4-propan-2-yloxypyrimidin-2-amine (PubChem CID 112636750) has the molecular formula C11H15N5O and a molecular weight of 233.28 g/mol. Its IUPAC name is N-(1-methylpyrazol-4-yl)-4-propan-2-yloxypyrimidin-2-amine.

Molecular Properties

Compound NameN-(1-methylpyrazol-4-yl)-4-propan-2-yloxypyrimidin-2-amine
PubChem CID112636750
Molecular FormulaC11H15N5O
Molecular Weight233.28 g/mol
Exact Mass233.13
IUPAC NameN-(1-methylpyrazol-4-yl)-4-propan-2-yloxypyrimidin-2-amine
SMILESCC(C)Oc1ccnc(Nc2cnn(C)c2)n1
InChIInChI=1S/C11H15N5O/c1-8(2)17-10-4-5-12-11(15-10)14-9-6-13-16(3)7-9/h4-8H,1-3H3,(H,12,14,15)
InChIKeyQUYHQHKYYFGXBM-UHFFFAOYSA-N
XLogP1.74
TPSA64.86 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.28
LogP ≤ 51.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

4-[4-(ethylamino)pyrazol-1-yl]-N-(1-methylpyrazol-4-yl)pyrimidin-2-amine
CID 151837932
N-(2-piperidin-1-ylethyl)-4-propan-2-yloxypyrimidin-2-amine
CID 112637281
1-[2-[(1-methylpyrazol-4-yl)amino]pyrimidin-4-yl]pyrrole-3-carboxylic acid
CID 151572944
cyclopropyl-[(1R,5R)-3-[2-[(1-methylpyrazol-4-yl)amino]pyrimidin-4-yl]-3,8-diazabicyclo[3.2.1]octan-8-yl]methanone
CID 155558729
N-(2,2-dicyclopropylethyl)-4-propan-2-yloxypyrimidin-2-amine
CID 112638038
N-(2-morpholin-4-ylethyl)-4-propan-2-yloxypyrimidin-2-amine
CID 112636541
N-[(1-methylpyrrolidin-2-yl)methyl]-4-propan-2-yloxypyrimidin-2-amine
CID 114138482
4-(4-bromo-1,3-thiazol-2-yl)-N-(1-methylpyrazol-4-yl)pyrimidin-2-amine
CID 170326720
2-chloro-5-[(4-propan-2-yloxypyrimidin-2-yl)amino]benzoic acid
CID 115974029
4-(2-hydrazinyl-4-pyridinyl)-N-(1-methylpyrazol-4-yl)pyrimidin-2-amine
CID 118209525
4-[[4-(methylamino)cyclohexyl]methoxy]-N-(1-propan-2-ylpyrazol-4-yl)pyrimidin-2-amine
CID 165385604
N-[[2-methyl-4-[2-[(1-methylpyrazol-4-yl)amino]pyrimidin-4-yl]-3-propan-2-yloxyphenyl]methyl]azetidine-1-carboxamide
CID 140917821

Frequently Asked Questions

What is the IUPAC name of N-(1-methylpyrazol-4-yl)-4-propan-2-yloxypyrimidin-2-amine?
The IUPAC name of N-(1-methylpyrazol-4-yl)-4-propan-2-yloxypyrimidin-2-amine (CID 112636750) is N-(1-methylpyrazol-4-yl)-4-propan-2-yloxypyrimidin-2-amine.
What is the SMILES notation for N-(1-methylpyrazol-4-yl)-4-propan-2-yloxypyrimidin-2-amine?
The canonical SMILES for N-(1-methylpyrazol-4-yl)-4-propan-2-yloxypyrimidin-2-amine is CC(C)Oc1ccnc(Nc2cnn(C)c2)n1.
What is the InChIKey of N-(1-methylpyrazol-4-yl)-4-propan-2-yloxypyrimidin-2-amine?
The InChIKey is QUYHQHKYYFGXBM-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15N5O/c1-8(2)17-10-4-5-12-11(15-10)14-9-6-13-16(3)7-9/h4-8H,1-3H3,(H,12,14,15).
What are the key properties of N-(1-methylpyrazol-4-yl)-4-propan-2-yloxypyrimidin-2-amine?
N-(1-methylpyrazol-4-yl)-4-propan-2-yloxypyrimidin-2-amine has a molecular weight of 233.28 g/mol, XLogP of 1.74, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-methylpyrazol-4-yl)-4-propan-2-yloxypyrimidin-2-amine is sourced from PubChem (CID 112636750), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).